REMARK  Name = BDB016082
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.084  -0.891   0.404  0.00  0.00    +0.133 A 
ATOM      2  C   LIG    1       -0.670  -2.075   1.021  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        0.697  -2.291   1.063  0.00  0.00    +0.125 A 
ATOM      4  N   LIG    1        1.616  -1.458   0.541  0.00  0.00    -0.235 NA
ATOM      5  C   LIG    1        1.134  -0.368  -0.075  0.00  0.00    +0.162 A 
ATOM      6  N   LIG    1       -0.176  -0.064  -0.162  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   2   7
ATOM      7  C   LIG    1       -1.549  -3.090   1.564  0.00  0.00    +0.024 A 
ATOM      8  C   LIG    1       -2.533  -3.742   0.851  0.00  0.00    +0.116 A 
ATOM      9  N   LIG    1       -3.100  -4.632   1.714  0.00  0.00    -0.274 N 
ATOM     10  C   LIG    1       -4.190  -5.537   1.438  0.00  0.00    +0.172 C 
ATOM     11  N   LIG    1       -2.538  -4.624   2.937  0.00  0.00    -0.179 NA
ATOM     12  C   LIG    1       -1.585  -3.693   2.840  0.00  0.00    +0.143 A 
ENDBRANCH   2   7
BRANCH   5  13
ATOM     13  C   LIG    1        2.102   0.565  -0.690  0.00  0.00    +0.020 A 
ATOM     14  C   LIG    1        3.493   0.344  -0.603  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1        4.427   1.219  -1.183  0.00  0.00    -0.014 A 
ATOM     16  C   LIG    1        3.958   2.347  -1.865  0.00  0.00    +0.008 A 
ATOM     17  C   LIG    1        2.590   2.591  -1.969  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1        1.676   1.710  -1.388  0.00  0.00    +0.011 A 
BRANCH  15  19
ATOM     19  C   LIG    1        5.851   0.952  -1.058  0.00  0.00    +0.020 A 
ATOM     20  C   LIG    1        6.820   1.342  -1.961  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1        8.008   0.877  -1.475  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1        9.311   1.031  -2.074  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1        7.889   0.209  -0.315  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1        6.577   0.251  -0.066  0.00  0.00    +0.142 A 
ENDBRANCH  15  19
ENDBRANCH   5  13
BRANCH   1  27
ATOM     25  C   LIG    1       -4.136   1.085  -0.009  0.00  0.00    +0.092 C 
ATOM     26  C   LIG    1       -2.753   0.649  -0.517  0.00  0.00    +0.128 C 
ATOM     27  N   LIG    1       -2.423  -0.508   0.325  0.00  0.00    -0.313 N 
ATOM     28  C   LIG    1       -3.205  -0.453   1.571  0.00  0.00    +0.108 C 
ATOM     29  C   LIG    1       -3.994   0.854   1.491  0.00  0.00    +0.043 C 
BRANCH  25  32
ATOM     30  C   LIG    1       -5.958   4.371  -0.480  0.00  0.00    +0.109 C 
ATOM     31  C   LIG    1       -5.785   2.897  -0.231  0.00  0.00    +0.210 C 
ATOM     32  N   LIG    1       -4.484   2.458  -0.333  0.00  0.00    -0.311 N 
ATOM     33  H   LIG    1       -3.747   3.151  -0.330  0.00  0.00    +0.149 HD
ATOM     34  O   LIG    1       -6.729   2.167   0.052  0.00  0.00    -0.276 OA
ENDBRANCH  25  32
ENDBRANCH   1  27
TORSDOF 5